SCHEMBL9067653

SCHEMBL9067653

CCC1[C]c2ccccc2CC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.37
PDPK1 O15530 1/20 0.34
MTNR1A P48039 5/20 0.34
MTNR1B P49286 2/20 0.34
DRD2 P14416 1/20 0.34
PLAU P00749 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10390219 1.00 HTR1A (0.37) HTR1APDPK1MTNR1AMTNR1BDRD2
SCHEMBL10390238 0.86 HTR1A (0.38) HTR1APDPK1MTNR1AMTNR1BDRD2
SCHEMBL3433317 0.82 DRD2 (0.36) HTR1ADRD2
SCHEMBL7977539 0.79 GRIN2B (0.43) HTR1A
SCHEMBL1752693 0.77 HTR1A (0.41) HTR1A
SCHEMBL2183528 0.75 PDPK1 (0.37) PDPK1MTNR1AMTNR1BDRD2PLAU
SCHEMBL1383876 0.71 ANPEP (0.39) PDPK1MTNR1AMTNR1BPLAU
SCHEMBL3653495 0.71 PLAU (0.41) PDPK1PLAU
SCHEMBL5714371 0.70 PRCP (0.36) HTR1APDPK1MTNR1AMTNR1BDRD2
SCHEMBL1634692 0.68 CYP11B2 (0.41) MTNR1AMTNR1BPLAUMAOAMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150291728-A1 EPOXY COMPOUND, PRODUCTION METHOD THEREFOR, AND CURABLE EPOXY RESIN COMPOSITION DAICEL CORPORATION (JP) 2015-10-15 US disclosed
EP-2921513-A1 EPOXY COMPOUND, PRODUCTION METHOD THEREFOR, AND CURABLE EPOXY RESIN COMPOSITION Daicel Corporation (JP) 2015-09-23 EP disclosed
US-5502207-A ALKENYL-SUBSTITUTED BISNADIMIDE MARUZEN PETROCHEMICAL CO., LTD. (JP) 1996-03-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150291728-A1 EPOXY COMPOUND, PRODUCTION METHOD THEREFOR, AND CURABLE EPOXY RESIN COMPOSITION CBR1, SEM1, EEF1A1 HTR1A 1196/4885PDPK1 4402/4885MTNR1A 2557/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.